diethylamino-[4-(3-sulfamoylphenyl)sulfonyliminocyclohexa-2,5-dien-1-ylidene]methanolate

Systemtic Name: diethylamino-[4-(3-sulfamoylphenyl)sulfonyliminocyclohexa-2,5-dien-1-ylidene]methanolate Openeye Name: diethylamino-[4-(3-sulfamoylphenyl)sulfonyliminocyclohexa-2,5-dien-1-ylidene]methanolate CAS Name: diethylamino-[4-(3-sulfamoylphenyl)sulfonylimino-1-cyclohexa-2,5-dienylidene]methanolate IUPAC Name: diethylamino-[4-(3-sulfamoylphenyl)sulfonyliminocyclohexa-2,5-dien-1-ylidene]methanolate Traditional Name: diethylamino-[4-(3-sulfamoylphenyl)sulfonyliminocyclohexa-2,5-dien-1-ylidene]methanolate Formula: C17H20N3O5S2- MolecularWeight: 410.4878

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=C1C=CC(=NS(=O)(=O)C2=CC(=CC=C2)S(=O)(=O)N)C=C1)[O-]

Isomeric SMILES

CCN(CC)C(=C1C=CC(=NS(=O)(=O)C2=CC(=CC=C2)S(=O)(=O)N)C=C1)[O-]

InChI

InChI=1S/C17H21N3O5S2/c1-3-20(4-2)17(21)13-8-10-14(11-9-13)19-27(24,25)16-7-5-6-15(12-16)26(18,22)23/h5-12,21H,3-4H2,1-2H3,(H2,18,22,23)/p-1